#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fi9 s ASP 2 N 0.00 6.95 0.16 1.61 2.15 -1.26 -4.67 116.67 121.60 1fi9 s ASP 2 Ca 0.00 1.91 -0.14 0.00 0.43 0.00 0.00 52.55 54.75 1fi9 s ASP 2 Cb 0.00 -2.55 0.05 0.00 -0.30 0.00 0.00 42.92 40.11 1fi9 s ASP 2 CO 0.00 -0.68 1.73 0.58 -0.17 0.00 0.00 175.17 176.64 1fi9 h VAL 3 N 5.10 1.20 0.44 1.11 2.07 -1.84 0.11 116.25 124.44 1fi9 h VAL 3 Ca -0.34 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1fi9 h VAL 3 Cb 1.16 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1fi9 h VAL 3 CO 0.91 0.23 -0.21 -0.33 0.02 0.00 0.00 177.57 178.19 1fi9 h GLU 4 N 0.69 -0.57 -0.16 1.57 4.39 -1.92 0.87 114.58 119.45 1fi9 h GLU 4 Ca 0.18 0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.95 1fi9 h GLU 4 Cb 0.14 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 1fi9 h GLU 4 CO -0.02 -0.31 -0.08 0.87 -1.16 0.00 0.00 179.01 178.31 1fi9 h LYS 5 N -0.72 -0.06 -0.87 2.33 1.57 -1.92 -2.24 116.57 114.67 1fi9 h LYS 5 Ca -0.06 0.00 0.23 0.00 -1.87 0.00 0.00 60.65 58.95 1fi9 h LYS 5 Cb 0.52 0.01 -0.15 0.00 0.08 0.00 0.00 32.23 32.69 1fi9 h LYS 5 CO 0.10 -0.04 0.14 0.78 -0.57 0.00 0.00 179.45 179.86 1fi9 h GLY 6 N -0.06 1.23 0.78 3.86 0.00 -0.45 0.42 103.07 108.85 1fi9 h GLY 6 Ca 0.09 0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.46 1fi9 h GLY 6 CO -0.20 -0.39 -0.17 1.70 0.00 0.00 0.00 176.54 177.48 1fi9 h LYS 7 N 0.13 -0.36 -0.67 4.80 3.64 -0.26 -0.25 116.57 123.61 1fi9 h LYS 7 Ca 0.53 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.90 1fi9 h LYS 7 Cb 1.07 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 1fi9 h LYS 7 CO -0.72 -0.24 0.27 0.87 -2.27 0.00 0.00 179.45 177.37 1fi9 h LYS 8 N -0.37 0.99 0.47 1.90 1.79 -0.25 -2.40 116.57 118.70 1fi9 h LYS 8 Ca 0.01 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.29 1fi9 h LYS 8 Cb 0.36 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.82 1fi9 h LYS 8 CO -0.05 0.82 -0.49 0.82 -1.08 0.00 0.00 179.45 179.47 1fi9 h ILE 9 N 0.94 0.05 -0.80 1.86 2.04 0.10 0.56 117.51 122.25 1fi9 h ILE 9 Ca 0.22 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.28 1fi9 h ILE 9 Cb 0.19 0.05 -0.13 0.00 -0.74 0.00 0.00 36.82 36.19 1fi9 h ILE 9 CO -0.02 0.00 0.12 0.15 0.00 0.00 0.00 178.15 178.40 1fi9 h PHE 10 N -0.97 0.16 0.00 1.37 3.57 -0.97 0.46 116.94 120.56 1fi9 h PHE 10 Ca -0.05 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 1fi9 h PHE 10 Cb 0.85 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.63 1fi9 h PHE 10 CO -0.26 -0.20 -0.35 0.28 -2.23 0.00 0.00 178.31 175.55 1fi9 h VAL 11 N 0.17 0.91 -0.02 1.41 2.07 -0.79 0.11 116.25 120.12 1fi9 h VAL 11 Ca 0.47 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.60 1fi9 h VAL 11 Cb 0.87 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 32.47 1fi9 h VAL 11 CO -0.64 0.34 -0.18 0.00 0.02 0.00 0.00 177.57 177.11 1fi9 n GLN 12 N -3.63 1.63 -0.02 1.57 1.13 0.19 -4.39 117.38 113.86 1fi9 n GLN 12 Ca -0.01 -1.31 -0.04 0.00 -1.94 0.00 0.00 57.00 53.70 1fi9 n GLN 12 Cb 0.46 -1.37 -0.02 0.00 0.11 0.00 0.00 30.24 29.43 1fi9 n GLN 12 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1fi9 n LYS 13 N 0.56 0.11 0.00 -1.09 4.01 0.13 -5.00 118.16 116.88 1fi9 n LYS 13 Ca 0.10 0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.94 1fi9 n LYS 13 Cb 0.45 -0.87 0.00 0.00 -0.51 0.00 0.00 35.03 34.10 1fi9 n LYS 13 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1fi9 n ALA 15 N -1.18 0.00 -1.03 0.00 0.00 -0.35 -3.56 120.51 114.39 1fi9 n ALA 15 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1fi9 n ALA 15 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 1fi9 n ALA 15 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fi9 n GLN 16 N 0.00 2.34 0.00 0.00 1.13 -1.26 -2.52 117.38 117.07 1fi9 n GLN 16 Ca 0.00 -1.26 0.00 0.00 -1.94 0.00 0.00 57.00 53.80 1fi9 n GLN 16 Cb 0.00 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.17 1fi9 n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fi9 s HIS 18 N -0.89 2.03 0.08 0.00 3.76 -1.05 -0.45 115.29 118.78 1fi9 s HIS 18 Ca 0.00 -0.40 0.10 0.00 -0.15 0.00 0.00 55.06 54.61 1fi9 s HIS 18 Cb 0.00 -1.13 -0.03 0.00 1.11 0.00 0.00 32.58 32.53 1fi9 s HIS 18 CO 0.00 0.24 -0.25 0.99 -0.85 0.00 0.00 174.74 174.87 1fi9 s THR 19 N -1.05 2.06 -0.09 1.30 2.01 -1.26 -4.19 115.64 114.42 1fi9 s THR 19 Ca 0.10 -1.52 0.18 0.00 0.31 0.00 0.00 61.69 60.75 1fi9 s THR 19 Cb -0.10 -1.80 0.39 0.00 0.01 0.00 0.00 72.50 71.00 1fi9 s THR 19 CO 0.04 0.19 1.18 1.33 -0.69 0.00 0.00 174.62 176.67 1fi9 n VAL 20 N 1.37 1.02 -4.35 3.82 0.24 -1.26 0.02 118.33 119.19 1fi9 n VAL 20 Ca -0.18 -1.92 -0.15 0.00 -2.04 0.00 0.00 64.34 60.05 1fi9 n VAL 20 Cb 0.53 0.38 -0.03 0.00 -1.47 0.00 0.00 33.84 33.25 1fi9 n VAL 20 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1fi9 n GLU 21 N -0.31 1.27 0.00 7.34 -0.58 -1.26 -3.59 120.64 123.51 1fi9 n GLU 21 Ca 0.11 -1.79 0.00 0.00 -0.42 0.00 0.00 57.16 55.06 1fi9 n GLU 21 Cb 0.90 0.57 0.00 0.00 -0.57 0.00 0.00 31.44 32.34 1fi9 n GLU 21 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1fi9 n LYS 22 N -0.59 0.00 -0.49 3.49 4.81 -1.26 -4.40 118.16 119.73 1fi9 n LYS 22 Ca -0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.33 1fi9 n LYS 22 Cb 0.31 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.33 1fi9 n LYS 22 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fi9 n GLY 23 N 3.01 2.21 1.54 3.14 0.00 -1.26 -4.40 105.19 109.44 1fi9 n GLY 23 Ca 0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.71 1fi9 n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fi9 n GLY 24 N 1.82 3.09 1.14 -0.02 0.00 -1.26 -5.01 105.19 104.95 1fi9 n GLY 24 Ca 0.07 -0.52 0.16 0.00 0.00 0.00 0.00 46.02 45.73 1fi9 n GLY 24 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fi9 n LYS 25 N -0.22 -2.31 -3.90 1.61 5.02 -1.26 -4.79 118.16 112.31 1fi9 n LYS 25 Ca 0.27 1.53 -0.24 0.00 -2.02 0.00 0.00 58.31 57.84 1fi9 n LYS 25 Cb 1.03 -2.81 -0.17 0.00 -0.02 0.00 0.00 35.03 33.05 1fi9 n LYS 25 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1fi9 s HIS 26 N -1.99 1.06 0.00 2.13 3.76 -1.26 -4.40 115.29 114.59 1fi9 s HIS 26 Ca 0.00 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 54.48 1fi9 s HIS 26 Cb 0.00 -0.99 0.00 0.00 1.11 0.00 0.00 32.58 32.70 1fi9 s HIS 26 CO 0.00 -0.40 0.00 1.63 -0.85 0.00 0.00 174.74 175.12 1fi9 n LYS 27 N 4.91 3.89 -0.17 1.40 4.76 -1.26 -4.99 118.16 126.70 1fi9 n LYS 27 Ca -0.12 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.28 1fi9 n LYS 27 Cb 0.50 0.00 0.06 0.00 -1.84 0.00 0.00 35.03 33.75 1fi9 n LYS 27 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1fi9 h THR 28 N 0.00 0.96 -3.56 -0.18 2.02 -1.93 -3.40 112.91 106.82 1fi9 h THR 28 Ca 0.00 -0.18 -0.52 0.00 0.77 0.00 0.00 66.41 66.48 1fi9 h THR 28 Cb 0.00 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 66.77 1fi9 h THR 28 CO 0.00 0.10 0.16 -0.83 0.37 0.00 0.00 175.52 175.32 1fi9 s GLY 29 N -2.85 2.79 0.64 2.16 0.00 0.41 -5.05 107.32 105.41 1fi9 s GLY 29 Ca -0.13 0.30 -0.17 0.00 0.00 0.00 0.00 44.72 44.72 1fi9 s GLY 29 CO 0.74 0.74 1.16 2.56 0.00 0.00 0.00 173.10 178.30 1fi9 s PRO 30 N -1.52 2.77 -0.46 2.90 0.04 -1.26 -4.53 135.00 132.92 1fi9 s PRO 30 Ca 0.39 1.64 -0.27 0.00 0.04 0.00 0.00 61.00 62.80 1fi9 s PRO 30 Cb -0.20 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 1fi9 s PRO 30 CO 0.24 -1.32 2.17 1.21 0.04 0.00 0.00 177.00 179.33 1fi9 s ASN 31 N -2.05 4.98 0.17 6.66 2.47 -1.26 -4.25 114.94 121.66 1fi9 s ASN 31 Ca 0.73 1.04 -0.14 0.00 0.42 0.00 0.00 52.86 54.90 1fi9 s ASN 31 Cb -0.26 -2.51 0.07 0.00 -1.45 0.00 0.00 41.25 37.10 1fi9 s ASN 31 CO 0.38 -2.47 1.82 -0.07 -3.72 0.00 0.00 177.10 173.04 1fi9 h LEU 32 N 17.40 0.53 0.00 3.21 3.38 -0.75 -3.46 115.31 135.62 1fi9 h LEU 32 Ca -0.28 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1fi9 h LEU 32 Cb 1.22 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1fi9 h LEU 32 CO 1.13 0.38 0.00 1.57 0.09 0.00 0.00 178.44 181.61 1fi9 n HIS 33 N -4.77 0.00 -1.08 1.13 -0.00 -1.26 -1.38 115.22 107.86 1fi9 n HIS 33 Ca 0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.21 1fi9 n HIS 33 Cb 0.05 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.92 1fi9 n HIS 33 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1fi9 n GLY 34 N 0.00 1.12 0.48 1.57 0.00 0.10 -4.99 105.19 103.48 1fi9 n GLY 34 Ca 0.00 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.36 1fi9 n GLY 34 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1fi9 h LEU 35 N 0.00 -1.18 -9.92 0.99 5.85 -1.47 -3.37 115.31 106.21 1fi9 h LEU 35 Ca 0.00 0.07 -0.53 0.00 0.84 0.00 0.00 57.88 58.26 1fi9 h LEU 35 Cb 0.54 0.35 0.08 0.00 0.37 0.00 0.00 40.66 42.00 1fi9 h LEU 35 CO 0.00 -0.70 0.66 -0.36 -0.34 0.00 0.00 178.44 177.70 1fi9 s PHE 36 N -5.70 2.84 0.00 1.25 0.08 -1.26 -3.12 117.98 112.07 1fi9 s PHE 36 Ca -0.18 1.35 0.00 0.00 0.12 0.00 0.00 56.93 58.23 1fi9 s PHE 36 Cb 0.03 -3.76 0.00 0.00 -0.57 0.00 0.00 43.02 38.71 1fi9 s PHE 36 CO 0.56 -2.24 0.00 0.41 -0.10 0.00 0.00 175.22 173.85 1fi9 n GLY 37 N 0.67 3.04 3.88 4.36 0.00 -1.26 -5.03 105.19 110.85 1fi9 n GLY 37 Ca 0.02 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.88 1fi9 n GLY 37 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fi9 s ARG 38 N 0.00 3.78 0.89 1.61 3.52 -1.18 -4.95 118.95 122.61 1fi9 s ARG 38 Ca 0.00 0.35 -0.12 0.00 -0.13 0.00 0.00 55.73 55.82 1fi9 s ARG 38 Cb 0.00 -2.51 0.12 0.00 -1.56 0.00 0.00 34.95 31.01 1fi9 s ARG 38 CO 0.00 0.12 1.13 0.15 -0.81 0.00 0.00 175.30 175.89 1fi9 s LYS 39 N -3.47 1.33 0.00 5.12 3.01 -1.26 -3.22 119.74 121.26 1fi9 s LYS 39 Ca 0.49 0.34 0.00 0.00 -1.01 0.00 0.00 55.97 55.79 1fi9 s LYS 39 Cb -0.11 -1.86 0.00 0.00 -1.01 0.00 0.00 37.83 34.86 1fi9 s LYS 39 CO 0.27 -2.07 0.96 0.25 0.51 0.00 0.00 175.35 175.26 1fi9 n THR 40 N -3.69 0.00 -1.13 2.17 -2.24 -0.66 -3.48 114.28 105.25 1fi9 n THR 40 Ca 0.07 1.46 -0.26 0.00 -2.27 0.00 0.00 64.05 63.04 1fi9 n THR 40 Cb 0.59 -2.44 -0.09 0.00 -2.10 0.00 0.00 70.33 66.29 1fi9 n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fi9 n GLY 41 N -0.96 3.62 2.68 3.38 0.00 -1.25 -4.01 105.19 108.67 1fi9 n GLY 41 Ca 0.00 -1.33 -0.08 0.00 0.00 0.00 0.00 46.02 44.62 1fi9 n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fi9 n GLN 42 N 3.14 1.22 -2.20 1.61 1.13 -1.23 -4.84 117.38 116.21 1fi9 n GLN 42 Ca 0.61 -3.26 -0.33 0.00 -1.94 0.00 0.00 57.00 52.08 1fi9 n GLN 42 Cb 0.52 -1.27 -0.00 0.00 0.11 0.00 0.00 30.24 29.59 1fi9 n GLN 42 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1fi9 s ALA 43 N -3.15 2.79 -0.07 -1.58 0.00 -1.26 -4.85 121.76 113.64 1fi9 s ALA 43 Ca 0.27 0.45 -0.09 0.00 0.00 0.00 0.00 51.96 52.59 1fi9 s ALA 43 Cb 0.44 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 20.27 1fi9 s ALA 43 CO 0.03 -0.64 0.35 -1.00 0.00 0.00 0.00 175.76 174.50 1fi9 h PRO 44 N 0.78 -0.25 -1.67 0.00 0.13 -1.97 -3.42 132.00 125.60 1fi9 h PRO 44 Ca -0.48 0.02 -0.46 0.00 -0.87 0.00 0.00 66.00 64.21 1fi9 h PRO 44 Cb 1.22 0.06 -0.36 0.00 0.13 0.00 0.00 31.00 32.05 1fi9 h PRO 44 CO 0.58 -0.13 -1.05 0.41 -0.23 0.00 0.00 178.00 177.58 1fi9 n GLY 45 N 1.08 2.85 3.17 1.56 0.00 -1.26 -5.10 105.19 107.49 1fi9 n GLY 45 Ca -0.04 -1.37 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 1fi9 n GLY 45 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1fi9 s PHE 46 N -1.58 0.94 -0.48 1.61 5.36 -1.26 -5.06 117.98 117.51 1fi9 s PHE 46 Ca 0.36 -1.10 -0.11 0.00 -0.96 0.00 0.00 56.93 55.12 1fi9 s PHE 46 Cb 0.28 -0.55 0.12 0.00 -0.34 0.00 0.00 43.02 42.53 1fi9 s PHE 46 CO -0.10 -0.35 0.37 0.99 -1.46 0.00 0.00 175.22 174.67 1fi9 s THR 47 N -3.85 4.45 0.95 0.12 2.01 -1.26 -4.90 115.64 113.16 1fi9 s THR 47 Ca 0.20 -1.67 -0.14 0.00 0.31 0.00 0.00 61.69 60.39 1fi9 s THR 47 Cb 0.07 -3.89 0.17 0.00 0.01 0.00 0.00 72.50 68.85 1fi9 s THR 47 CO 0.00 -0.77 1.20 -0.72 -0.69 0.00 0.00 174.62 173.64 1fi9 s TYR 48 N 1.42 2.05 0.45 4.92 -0.85 -1.26 -5.11 117.35 118.98 1fi9 s TYR 48 Ca 0.05 0.63 0.05 0.00 -0.52 0.00 0.00 57.07 57.28 1fi9 s TYR 48 Cb -0.27 -3.63 -0.04 0.00 0.38 0.00 0.00 41.96 38.40 1fi9 s TYR 48 CO 0.00 -2.54 0.08 0.95 -1.52 0.00 0.00 175.55 172.52 1fi9 s THR 49 N -3.48 1.81 0.00 -3.49 -4.23 -1.26 -5.03 115.64 99.96 1fi9 s THR 49 Ca 0.67 -1.88 -0.04 0.00 -1.18 0.00 0.00 61.69 59.27 1fi9 s THR 49 Cb -0.10 -2.69 -0.16 0.00 1.34 0.00 0.00 72.50 70.88 1fi9 s THR 49 CO 0.53 0.00 2.45 -0.90 -0.54 0.00 0.00 174.62 176.16 1fi9 n ASP 50 N -1.19 3.40 0.00 3.99 5.75 -1.26 -2.96 116.55 124.28 1fi9 n ASP 50 Ca -0.08 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.58 1fi9 n ASP 50 Cb 0.66 -0.91 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 1fi9 n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1fi9 n ALA 51 N 2.61 0.00 0.07 2.12 0.00 -1.26 -4.71 120.51 119.34 1fi9 n ALA 51 Ca 0.26 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.57 1fi9 n ALA 51 Cb 0.58 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.94 1fi9 n ALA 51 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1fi9 h ASN 52 N 0.00 -0.15 -0.36 0.00 -1.24 -1.76 -1.87 115.58 110.21 1fi9 h ASN 52 Ca 0.00 -0.26 -0.01 0.00 0.71 0.00 0.00 56.30 56.74 1fi9 h ASN 52 Cb 0.00 0.04 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 1fi9 h ASN 52 CO 0.00 0.19 0.19 0.50 -1.29 0.00 0.00 177.43 177.02 1fi9 h LYS 53 N -0.50 0.51 -0.33 6.67 3.11 -1.88 -2.19 116.57 121.96 1fi9 h LYS 53 Ca -0.02 -0.06 0.10 0.00 -2.81 0.00 0.00 60.65 57.86 1fi9 h LYS 53 Cb 0.40 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 1fi9 h LYS 53 CO 0.03 0.42 0.29 -0.97 -2.81 0.00 0.00 179.45 176.41 1fi9 h ASN 54 N 0.45 0.00 0.05 4.20 -0.73 -1.82 -0.49 115.58 117.24 1fi9 h ASN 54 Ca 0.13 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.29 1fi9 h ASN 54 Cb 0.07 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.66 1fi9 h ASN 54 CO -0.02 0.00 -0.02 0.50 -0.37 0.00 0.00 177.43 177.52 1fi9 h LYS 55 N 0.00 -0.06 -6.34 6.67 3.64 -0.67 -3.47 116.57 116.33 1fi9 h LYS 55 Ca 0.16 0.00 -0.47 0.00 -1.27 0.00 0.00 60.65 59.07 1fi9 h LYS 55 Cb 0.74 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.53 1fi9 h LYS 55 CO -0.00 0.12 -0.81 0.41 -2.27 0.00 0.00 179.45 176.90 1fi9 n GLY 56 N -0.64 -0.38 3.67 5.01 0.00 -0.19 -4.99 105.19 107.67 1fi9 n GLY 56 Ca -0.08 0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 1fi9 n GLY 56 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fi9 s ILE 57 N -3.53 3.63 -0.12 -0.61 -4.36 -1.26 -4.90 121.20 110.05 1fi9 s ILE 57 Ca 0.36 -1.69 -0.29 0.00 -0.26 0.00 0.00 60.65 58.76 1fi9 s ILE 57 Cb -0.18 -2.90 -0.01 0.00 1.25 0.00 0.00 42.46 40.61 1fi9 s ILE 57 CO 0.85 -0.28 1.01 0.42 0.24 0.00 0.00 174.94 177.19 1fi9 s THR 58 N -2.08 4.77 -0.55 8.37 -4.23 -1.26 -1.66 115.64 119.00 1fi9 s THR 58 Ca 0.30 2.04 -0.27 0.00 -1.18 0.00 0.00 61.69 62.58 1fi9 s THR 58 Cb -0.08 -4.31 -0.02 0.00 1.34 0.00 0.00 72.50 69.43 1fi9 s THR 58 CO 0.20 -0.01 1.83 0.26 -0.54 0.00 0.00 174.62 176.35 1fi9 s TRP 59 N 2.12 1.72 0.24 3.99 0.52 -1.20 -4.74 118.94 121.59 1fi9 s TRP 59 Ca 0.48 0.76 0.04 0.00 0.02 0.00 0.00 56.10 57.39 1fi9 s TRP 59 Cb -0.18 -4.11 -0.05 0.00 -1.15 0.00 0.00 33.47 27.98 1fi9 s TRP 59 CO 0.17 -2.41 -0.01 -1.59 0.02 0.00 0.00 176.95 173.14 1fi9 s LYS 60 N 6.69 1.36 0.30 4.98 -2.85 -1.26 -4.01 119.74 124.94 1fi9 s LYS 60 Ca 0.69 -1.69 0.05 0.00 -1.00 0.00 0.00 55.97 54.03 1fi9 s LYS 60 Cb -0.14 -0.66 0.81 0.00 -2.06 0.00 0.00 37.83 35.78 1fi9 s LYS 60 CO 0.24 -0.09 1.64 1.05 0.10 0.00 0.00 175.35 178.29 1fi9 h GLU 61 N 2.45 0.20 -0.11 1.78 4.11 -1.98 0.20 114.58 121.22 1fi9 h GLU 61 Ca -0.38 -0.01 0.03 0.00 0.07 0.00 0.00 59.36 59.06 1fi9 h GLU 61 Cb 1.22 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.37 1fi9 h GLU 61 CO 0.65 0.13 -0.49 1.49 0.07 0.00 0.00 179.01 180.85 1fi9 h GLU 62 N 0.20 -0.52 -0.17 1.06 4.81 -1.96 0.30 114.58 118.30 1fi9 h GLU 62 Ca 0.60 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.85 1fi9 h GLU 62 Cb 1.27 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.76 1fi9 h GLU 62 CO -0.67 -0.35 0.04 1.79 -0.73 0.00 0.00 179.01 179.09 1fi9 h THR 63 N -0.54 1.20 -0.40 0.32 1.35 -0.97 -0.93 112.91 112.94 1fi9 h THR 63 Ca 0.03 -0.64 0.08 0.00 -0.55 0.00 0.00 66.41 65.33 1fi9 h THR 63 Cb 0.62 1.29 -0.07 0.00 -1.73 0.00 0.00 68.15 68.27 1fi9 h THR 63 CO -0.39 0.20 -0.05 -0.07 -0.25 0.00 0.00 175.52 174.96 1fi9 h LEU 64 N 0.09 -0.27 -1.93 3.87 4.07 -1.11 -0.83 115.31 119.20 1fi9 h LEU 64 Ca 0.05 0.11 0.06 0.00 0.08 0.00 0.00 57.88 58.18 1fi9 h LEU 64 Cb 0.26 0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 1fi9 h LEU 64 CO 0.00 -0.09 0.18 0.24 -1.08 0.00 0.00 178.44 177.69 1fi9 h MET 65 N 0.05 0.09 -0.67 1.13 2.86 0.45 0.27 114.93 119.11 1fi9 h MET 65 Ca 0.20 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 1fi9 h MET 65 Cb 0.30 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1fi9 h MET 65 CO -0.38 0.06 0.00 0.39 1.06 0.00 0.00 176.91 178.04 1fi9 n GLU 66 N -4.48 3.39 0.04 1.72 -0.58 -0.43 -3.84 120.64 116.46 1fi9 n GLU 66 Ca 0.03 -2.71 0.00 0.00 -0.42 0.00 0.00 57.16 54.06 1fi9 n GLU 66 Cb 0.27 -1.80 0.00 0.00 -0.57 0.00 0.00 31.44 29.35 1fi9 n GLU 66 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 1fi9 n TYR 67 N 1.22 -0.21 0.31 -0.32 9.36 0.13 -4.19 117.16 123.46 1fi9 n TYR 67 Ca 0.25 0.04 0.18 0.00 3.32 0.00 0.00 57.90 61.69 1fi9 n TYR 67 Cb 0.80 0.07 1.00 0.00 -0.63 0.00 0.00 39.34 40.59 1fi9 n TYR 67 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 1fi9 h LEU 68 N 0.00 0.00 -3.30 2.98 3.38 -0.81 0.81 115.31 118.37 1fi9 h LEU 68 Ca 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1fi9 h LEU 68 Cb 0.34 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 1fi9 h LEU 68 CO 0.00 0.02 -0.02 1.21 0.09 0.00 0.00 178.44 179.74 1fi9 n GLU 69 N -3.41 2.34 -2.66 1.13 2.13 -1.25 -0.17 120.64 118.75 1fi9 n GLU 69 Ca -0.02 -2.98 -0.03 0.00 0.66 0.00 0.00 57.16 54.79 1fi9 n GLU 69 Cb 0.12 -1.82 0.11 0.00 0.27 0.00 0.00 31.44 30.12 1fi9 n GLU 69 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1fi9 n ASN 70 N -0.85 -1.23 -0.18 4.31 3.02 0.11 -4.75 115.26 115.70 1fi9 n ASN 70 Ca 0.27 -1.86 -0.08 0.00 -0.03 0.00 0.00 54.58 52.88 1fi9 n ASN 70 Cb 0.95 1.11 0.01 0.00 -0.61 0.00 0.00 39.78 41.24 1fi9 n ASN 70 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1fi9 h PRO 71 N 2.28 0.74 -1.41 3.52 0.13 -1.32 -2.74 132.00 133.20 1fi9 h PRO 71 Ca -0.31 -0.13 -0.33 0.00 -0.87 0.00 0.00 66.00 64.36 1fi9 h PRO 71 Cb 1.22 -0.12 -0.15 0.00 0.13 0.00 0.00 31.00 32.07 1fi9 h PRO 71 CO -0.02 0.65 0.43 0.36 -0.23 0.00 0.00 178.00 179.19 1fi9 n LYS 72 N -4.57 1.82 0.05 0.86 0.00 -1.26 -4.11 118.16 110.95 1fi9 n LYS 72 Ca 0.02 -1.65 0.00 0.00 -0.00 0.00 0.00 58.31 56.68 1fi9 n LYS 72 Cb 0.15 -1.65 0.00 0.00 -0.00 0.00 0.00 35.03 33.53 1fi9 n LYS 72 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1fi9 n LYS 73 N 0.17 0.00 -1.52 -1.58 3.00 -1.03 -4.81 118.16 112.39 1fi9 n LYS 73 Ca 0.32 0.00 -0.41 0.00 -0.00 0.00 0.00 58.31 58.22 1fi9 n LYS 73 Cb 0.66 -0.32 -0.04 0.00 0.00 0.00 0.00 35.03 35.34 1fi9 n LYS 73 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1fi9 n TYR 74 N -3.19 2.59 -1.29 5.64 4.02 -1.23 -4.61 117.16 119.08 1fi9 n TYR 74 Ca 0.00 -2.11 0.00 0.00 -0.01 0.00 0.00 57.90 55.78 1fi9 n TYR 74 Cb 0.14 -2.10 0.00 0.00 -0.02 0.00 0.00 39.34 37.36 1fi9 n TYR 74 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1fi9 n ILE 75 N 6.07 -7.26 -1.37 -0.72 -0.00 -1.26 -4.76 119.36 110.06 1fi9 n ILE 75 Ca 0.49 1.54 -0.38 0.00 -0.00 0.00 0.00 62.75 64.40 1fi9 n ILE 75 Cb 0.41 -3.79 -0.02 0.00 -0.00 0.00 0.00 39.64 36.25 1fi9 n ILE 75 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 1fi9 n PRO 76 N 0.86 3.17 -2.68 0.38 -0.04 -1.26 -4.16 135.00 131.26 1fi9 n PRO 76 Ca 0.00 -2.23 -0.15 0.00 -0.04 0.00 0.00 63.50 61.08 1fi9 n PRO 76 Cb 0.00 -2.92 0.01 0.00 -0.04 0.00 0.00 33.50 30.55 1fi9 n PRO 76 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fi9 n GLY 77 N 3.81 3.08 0.24 0.55 0.00 -1.26 -5.05 105.19 106.55 1fi9 n GLY 77 Ca 0.66 -1.78 -0.02 0.00 0.00 0.00 0.00 46.02 44.87 1fi9 n GLY 77 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1fi9 n THR 78 N -0.15 0.00 0.02 2.61 5.66 -1.26 -4.49 114.28 116.68 1fi9 n THR 78 Ca 0.19 -0.15 -0.11 0.00 -3.05 0.00 0.00 64.05 60.93 1fi9 n THR 78 Cb 0.74 -0.12 -0.14 0.00 -1.55 0.00 0.00 70.33 69.27 1fi9 n THR 78 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 1fi9 h LYS 79 N 0.00 0.08 -2.68 1.09 -0.00 -1.96 -3.52 116.57 109.58 1fi9 h LYS 79 Ca -0.03 -0.13 0.08 0.00 -0.00 0.00 0.00 60.65 60.57 1fi9 h LYS 79 Cb 0.08 0.05 -0.05 0.00 -0.00 0.00 0.00 32.23 32.32 1fi9 h LYS 79 CO 0.04 0.82 -0.78 -0.12 -0.00 0.00 0.00 179.45 179.40 1fi9 n MET 80 N -3.25 -2.83 0.00 0.07 0.00 -1.26 -5.05 117.12 104.80 1fi9 n MET 80 Ca -0.13 2.23 0.00 0.00 -0.00 0.00 0.00 57.70 59.80 1fi9 n MET 80 Cb 1.02 -2.90 0.00 0.00 0.00 0.00 0.00 33.22 31.34 1fi9 n MET 80 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 1fi9 n ILE 81 N -2.76 0.00 -3.68 1.12 -5.35 -1.26 -5.13 119.36 102.30 1fi9 n ILE 81 Ca -0.02 0.00 -0.08 0.00 -0.27 0.00 0.00 62.75 62.38 1fi9 n ILE 81 Cb 0.40 -0.17 0.03 0.00 -1.74 0.00 0.00 39.64 38.16 1fi9 n ILE 81 CO 0.00 0.00 0.00 2.22 -1.76 0.00 0.00 176.55 177.01 1fi9 n PHE 82 N -1.45 -2.16 0.04 4.28 1.16 -1.26 -5.08 117.46 113.00 1fi9 n PHE 82 Ca 0.00 -1.58 -0.08 0.00 -1.87 0.00 0.00 57.45 53.92 1fi9 n PHE 82 Cb 0.12 0.79 -0.05 0.00 -1.61 0.00 0.00 39.48 38.74 1fi9 n PHE 82 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1fi9 h ALA 83 N 2.00 -0.74 -1.83 1.98 0.00 -1.99 -3.44 119.26 115.24 1fi9 h ALA 83 Ca -0.29 -0.05 0.33 0.00 0.00 0.00 0.00 54.91 54.91 1fi9 h ALA 83 Cb 1.06 0.70 -0.09 0.00 0.00 0.00 0.00 17.79 19.46 1fi9 h ALA 83 CO 0.36 -0.81 0.86 0.20 0.00 0.00 0.00 179.25 179.86 1fi9 s GLY 84 N -1.59 -0.25 0.78 0.00 0.00 -1.26 -4.16 107.32 100.84 1fi9 s GLY 84 Ca -0.08 0.32 -0.15 0.00 0.00 0.00 0.00 44.72 44.81 1fi9 s GLY 84 CO 0.29 3.03 0.88 1.39 0.00 0.00 0.00 173.10 178.70 1fi9 n ILE 85 N -0.71 1.98 -0.33 0.90 2.08 0.76 -4.88 119.36 119.15 1fi9 n ILE 85 Ca -0.02 -0.30 0.07 0.00 0.56 0.00 0.00 62.75 63.06 1fi9 n ILE 85 Cb 0.61 -1.00 0.16 0.00 -0.75 0.00 0.00 39.64 38.66 1fi9 n ILE 85 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 1fi9 h LYS 86 N -0.66 0.01 0.00 0.38 1.57 -1.97 -3.45 116.57 112.44 1fi9 h LYS 86 Ca -0.46 -0.00 0.19 0.00 -1.87 0.00 0.00 60.65 58.51 1fi9 h LYS 86 Cb 1.32 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.59 1fi9 h LYS 86 CO 0.44 0.00 0.52 0.36 -0.57 0.00 0.00 179.45 180.21 1fi9 n LYS 87 N -5.56 0.14 -0.19 3.15 2.85 -1.26 -5.02 118.16 112.27 1fi9 n LYS 87 Ca 0.16 -0.52 -0.02 0.00 -1.05 0.00 0.00 58.31 56.88 1fi9 n LYS 87 Cb 0.53 0.82 0.08 0.00 -0.65 0.00 0.00 35.03 35.81 1fi9 n LYS 87 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 177.40 178.92 1fi9 h LYS 88 N 0.00 0.46 -0.23 -1.58 2.10 -1.99 -0.77 116.57 114.56 1fi9 h LYS 88 Ca -0.13 -0.03 0.04 0.00 -2.00 0.00 0.00 60.65 58.53 1fi9 h LYS 88 Cb 0.71 -0.10 -0.07 0.00 -0.90 0.00 0.00 32.23 31.87 1fi9 h LYS 88 CO 0.19 0.30 -0.54 1.15 -2.00 0.00 0.00 179.45 178.55 1fi9 h THR 89 N 0.47 0.00 0.02 0.07 2.02 -1.99 0.16 112.91 113.66 1fi9 h THR 89 Ca 0.26 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.46 1fi9 h THR 89 Cb 0.24 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.63 1fi9 h THR 89 CO -0.22 0.00 -0.11 -0.33 0.37 0.00 0.00 175.52 175.23 1fi9 h GLU 90 N -0.51 -0.19 -0.51 6.66 5.08 -1.88 -0.86 114.58 122.37 1fi9 h GLU 90 Ca 0.05 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.51 1fi9 h GLU 90 Cb 0.64 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.86 1fi9 h GLU 90 CO -0.49 -0.13 0.10 -0.09 -1.00 0.00 0.00 179.01 177.41 1fi9 h ARG 91 N -0.20 0.23 0.70 2.33 2.43 -0.44 0.20 114.38 119.63 1fi9 h ARG 91 Ca 0.03 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 1fi9 h ARG 91 Cb 0.24 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1fi9 h ARG 91 CO -0.10 0.15 -0.38 0.93 -1.51 0.00 0.00 179.97 179.07 1fi9 h GLU 92 N 0.24 -0.96 -0.50 0.20 4.39 -0.46 -0.02 114.58 117.47 1fi9 h GLU 92 Ca 0.26 0.07 0.10 0.00 0.34 0.00 0.00 59.36 60.12 1fi9 h GLU 92 Cb 0.35 0.22 -0.09 0.00 -0.10 0.00 0.00 28.75 29.13 1fi9 h GLU 92 CO -0.34 -0.64 -0.08 -0.44 -1.16 0.00 0.00 179.01 176.35 1fi9 h ASP 93 N -0.99 -0.38 -0.03 1.42 3.32 -0.60 0.16 116.42 119.32 1fi9 h ASP 93 Ca -0.09 0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.12 1fi9 h ASP 93 Cb 0.78 0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.55 1fi9 h ASP 93 CO 0.13 -0.14 -0.52 0.25 -1.72 0.00 0.00 179.24 177.24 1fi9 h LEU 94 N 0.03 -1.61 -0.79 1.55 6.46 -0.42 -0.63 115.31 119.91 1fi9 h LEU 94 Ca 0.25 0.18 0.18 0.00 -0.12 0.00 0.00 57.88 58.37 1fi9 h LEU 94 Cb 0.38 0.62 -0.11 0.00 -0.73 0.00 0.00 40.66 40.81 1fi9 h LEU 94 CO -0.49 -0.51 0.24 0.40 -0.62 0.00 0.00 178.44 177.47 1fi9 h ILE 95 N -0.64 0.51 -0.31 4.05 5.03 -0.10 0.16 117.51 126.21 1fi9 h ILE 95 Ca 0.02 -0.11 0.05 0.00 -0.12 0.00 0.00 64.86 64.71 1fi9 h ILE 95 Cb 0.71 0.16 -0.05 0.00 -3.03 0.00 0.00 36.82 34.61 1fi9 h ILE 95 CO -0.37 0.06 0.01 0.00 -0.68 0.00 0.00 178.15 177.17 1fi9 h ALA 96 N 1.64 0.29 0.76 1.87 0.00 0.80 0.25 119.26 124.86 1fi9 h ALA 96 Ca 0.46 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.41 1fi9 h ALA 96 Cb 0.80 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1fi9 h ALA 96 CO -0.51 -0.40 -0.41 -0.92 0.00 0.00 0.00 179.25 177.01 1fi9 h TYR 97 N 0.10 -1.08 -0.98 0.00 3.20 -0.57 -3.27 116.97 114.37 1fi9 h TYR 97 Ca 0.15 -0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.14 1fi9 h TYR 97 Cb 0.19 0.37 -0.15 0.00 1.54 0.00 0.00 36.73 38.69 1fi9 h TYR 97 CO -0.22 -0.64 -0.43 1.25 -1.64 0.00 0.00 178.16 176.48 1fi9 h LEU 98 N -1.08 -1.59 -0.96 2.82 5.85 -0.37 0.27 115.31 120.26 1fi9 h LEU 98 Ca -0.10 0.31 0.21 0.00 0.84 0.00 0.00 57.88 59.14 1fi9 h LEU 98 Cb 0.84 0.79 -0.18 0.00 0.37 0.00 0.00 40.66 42.49 1fi9 h LEU 98 CO 0.14 -0.28 -0.18 0.29 -0.34 0.00 0.00 178.44 178.07 1fi9 n LYS 99 N -5.42 -0.08 0.05 1.25 5.02 0.81 -0.53 118.16 119.25 1fi9 n LYS 99 Ca 0.08 1.48 -0.03 0.00 -2.02 0.00 0.00 58.31 57.82 1fi9 n LYS 99 Cb 0.37 -2.24 -0.01 0.00 -0.02 0.00 0.00 35.03 33.13 1fi9 n LYS 99 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1fi9 h LYS 100 N 0.00 -0.17 -0.71 1.97 1.79 -0.77 -3.35 116.57 115.33 1fi9 h LYS 100 Ca 0.49 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 59.06 1fi9 h LYS 100 Cb 0.80 0.04 -0.12 0.00 -1.58 0.00 0.00 32.23 31.38 1fi9 h LYS 100 CO -0.97 -0.11 -0.46 0.00 -1.08 0.00 0.00 179.45 176.83 1fi9 h ALA 101 N -1.50 -0.30 -0.11 3.86 0.00 0.46 0.53 119.26 122.20 1fi9 h ALA 101 Ca -0.02 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1fi9 h ALA 101 Cb 0.13 1.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1fi9 h ALA 101 CO 0.03 -0.83 0.01 1.79 0.00 0.00 0.00 179.25 180.25 1fi9 h THR 102 N -0.16 1.08 -0.21 0.00 1.35 -0.86 0.15 112.91 114.25 1fi9 h THR 102 Ca 0.20 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1fi9 h THR 102 Cb 0.55 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1fi9 h THR 102 CO -0.78 0.09 0.00 0.59 -0.25 0.00 0.00 175.52 175.18 1fi9 n ASN 103 N -4.44 2.54 0.00 5.36 3.02 0.15 0.00 115.26 121.90 1fi9 n ASN 103 Ca -0.01 -1.84 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 1fi9 n ASN 103 Cb 0.14 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 1fi9 n ASN 103 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85